methyl 3-[1-methyl-8-nitro-4-oxidanylidene-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoate

Systemtic Name: methyl 3-[1-methyl-8-nitro-4-oxidanylidene-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoate Openeye Name: methyl 3-[1-methyl-8-nitro-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoate CAS Name: 3-[1-methyl-8-nitro-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-methyl-8-nitro-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoate Traditional Name: 3-[4-keto-1-methyl-8-nitro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propionic acid methyl ester Formula: C16H13F3N4O5 MolecularWeight: 398.29343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2N1C3=C(C=C(C(=C3)[N+](=O)[O-])C(F)(F)F)NC2=O)CCC(=O)OC

Isomeric SMILES

CC1=C(N=C2N1C3=C(C=C(C(=C3)[N+](=O)[O-])C(F)(F)F)NC2=O)CCC(=O)OC

InChI

InChI=1S/C16H13F3N4O5/c1-7-9(3-4-13(24)28-2)20-14-15(25)21-10-5-8(16(17,18)19)11(23(26)27)6-12(10)22(7)14/h5-6H,3-4H2,1-2H3,(H,21,25)